CHEMBL71397


SMILES CN(CC(CCN1CCC(O)(c2ccccc2)CC1)c1ccc(Cl)c(Cl)c1)C(=O)c1ccccc1
InChIKey KBIKENJDJYPBNS-UHFFFAOYSA-N

Chemical properties

Hydrogen bond acceptors 3
Hydrogen bond donors 1
Rotatable bonds 8
Molecular weight (Da) 510.2

Drug properties

Molecular type Small molecule
Endogenous/Surrogate Surrogate
Approved drug No

Database connections

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Bovine Tachykinin A pKi 9.0 9.0 9.0 ChEMBL
NK2 NK2R Rat Tachykinin A pKi 9.0 9.0 9.0 ChEMBL
NK1 NK1R Human Tachykinin A pKd 9.5 9.5 9.5 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
NK2 NK2R Human Tachykinin A pIC50 8.05 8.05 8.05 ChEMBL